N-[6-fluoranyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[6-fluoranyl-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[6-fluoro-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[6-fluoro-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[6-fluoro-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[6-fluoro-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-3-methoxy-2-naphthamide Formula: C22H19FN2O2S2 MolecularWeight: 426.526863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)N=C3N(C4=C(S3)C=C(C=C4)F)CCSC

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)N=C3N(C4=C(S3)C=C(C=C4)F)CCSC

InChI

InChI=1S/C22H19FN2O2S2/c1-27-19-12-15-6-4-3-5-14(15)11-17(19)21(26)24-22-25(9-10-28-2)18-8-7-16(23)13-20(18)29-22/h3-8,11-13H,9-10H2,1-2H3